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121693-20-7 | 2H-Pyran, 3-bromo-2-(2-buten-1-yloxy)tetrahydro-
CAS No: 121693-20-7 Catalog No: AG0015KN MDL No:
Product Description
Catalog Number:
AG0015KN
Chemical Name:
2H-Pyran, 3-bromo-2-(2-buten-1-yloxy)tetrahydro-
CAS Number:
121693-20-7
Molecular Formula:
C9H15BrO2
Molecular Weight:
235.1182
IUPAC Name:
3-bromo-2-but-2-enoxyoxane
InChI:
InChI=1S/C9H15BrO2/c1-2-3-6-11-9-8(10)5-4-7-12-9/h2-3,8-9H,4-7H2,1H3
InChI Key:
CYEZOAFDSRYUAU-UHFFFAOYSA-N
SMILES:
CC=CCOC1OCCCC1Br
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.121g/mol
Monoisotopic Mass:
234.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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